4-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one

Systemtic Name: 4-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 4-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one CAS Name: 4-[[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-2-one IUPAC Name: 4-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]carbostyril Formula: C25H20N4O2S MolecularWeight: 440.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=O)NC4=CC=CC=C43)COC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=O)NC4=CC=CC=C43)COC5=CC=CC=C5

InChI

InChI=1S/C25H20N4O2S/c30-24-15-18(21-13-7-8-14-22(21)26-24)17-32-25-28-27-23(16-31-20-11-5-2-6-12-20)29(25)19-9-3-1-4-10-19/h1-15H,16-17H2,(H,26,30)